[(4-bromo-1-methylpyrazol-5-yl)-(4-bromophenyl)methyl]hydrazine

C11H12Br2N4 — CID 105192475

IUPAC[(4-bromo-1-methylpyrazol-5-yl)-(4-bromophenyl)methyl]hydrazine
SMILESCn1ncc(Br)c1C(NN)c1ccc(Br)cc1
InChIInChI=1S/C11H12Br2N4/c1-17-11(9(13)6-15-17)10(16-14)7-2-4-8(12)5-3-7/h2-6,10,16H,14H2,1H3
InChIKeySEAYSGYMZYJMQQ-UHFFFAOYSA-N
MW360.05 g/mol
LogP2.50
Rot. Bonds3

About [(4-bromo-1-methylpyrazol-5-yl)-(4-bromophenyl)methyl]hydrazine

[(4-bromo-1-methylpyrazol-5-yl)-(4-bromophenyl)methyl]hydrazine (PubChem CID 105192475) has the molecular formula C11H12Br2N4 and a molecular weight of 360.05 g/mol. Its IUPAC name is [(4-bromo-1-methylpyrazol-5-yl)-(4-bromophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-bromo-1-methylpyrazol-5-yl)-(4-bromophenyl)methyl]hydrazine
PubChem CID105192475
Molecular FormulaC11H12Br2N4
Molecular Weight360.05 g/mol
Exact Mass357.94
IUPAC Name[(4-bromo-1-methylpyrazol-5-yl)-(4-bromophenyl)methyl]hydrazine
SMILESCn1ncc(Br)c1C(NN)c1ccc(Br)cc1
InChIInChI=1S/C11H12Br2N4/c1-17-11(9(13)6-15-17)10(16-14)7-2-4-8(12)5-3-7/h2-6,10,16H,14H2,1H3
InChIKeySEAYSGYMZYJMQQ-UHFFFAOYSA-N
XLogP2.50
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.05
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [(4-bromo-1-methylpyrazol-5-yl)-(4-bromophenyl)methyl]hydrazine?
The IUPAC name of [(4-bromo-1-methylpyrazol-5-yl)-(4-bromophenyl)methyl]hydrazine (CID 105192475) is [(4-bromo-1-methylpyrazol-5-yl)-(4-bromophenyl)methyl]hydrazine.
What is the SMILES notation for [(4-bromo-1-methylpyrazol-5-yl)-(4-bromophenyl)methyl]hydrazine?
The canonical SMILES for [(4-bromo-1-methylpyrazol-5-yl)-(4-bromophenyl)methyl]hydrazine is Cn1ncc(Br)c1C(NN)c1ccc(Br)cc1.
What is the InChIKey of [(4-bromo-1-methylpyrazol-5-yl)-(4-bromophenyl)methyl]hydrazine?
The InChIKey is SEAYSGYMZYJMQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12Br2N4/c1-17-11(9(13)6-15-17)10(16-14)7-2-4-8(12)5-3-7/h2-6,10,16H,14H2,1H3.
What are the key properties of [(4-bromo-1-methylpyrazol-5-yl)-(4-bromophenyl)methyl]hydrazine?
[(4-bromo-1-methylpyrazol-5-yl)-(4-bromophenyl)methyl]hydrazine has a molecular weight of 360.05 g/mol, XLogP of 2.50, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-bromo-1-methylpyrazol-5-yl)-(4-bromophenyl)methyl]hydrazine is sourced from PubChem (CID 105192475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).